SCHEMBL7176296

SCHEMBL7176296

CCCc1c(OC)c(OC)c(C(=O)O)c2ccc(C)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 5/20 0.65
LDHB P07195 5/20 0.65
ALB P02768 1/20 0.42
HSD17B10 Q99714 3/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
DPP4 P27487 1/20 0.34
PPARA Q07869 1/20 0.34
PSMD14 O00487 1/20 0.34
RECQL P46063 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7186222 0.85 LDHA (0.62) LDHALDHBHSD17B10MEN1KMT2A
SCHEMBL7176330 0.80 LDHA (0.59) LDHALDHBALBHSD17B10MEN1
SCHEMBL7174623 0.79 LDHA (1.00) LDHALDHBALBHSD17B10TSHR
SCHEMBL7180813 0.77 LDHA (0.70) LDHALDHBMEN1KMT2ASMN1; SMN2
SCHEMBL8460263 0.75 LDHA (0.65) LDHALDHBALBHSD17B10MEN1
SCHEMBL9627592 0.75 ABCB11 (0.51) LDHALDHBHSD17B10TSHRMEN1
SCHEMBL9657958 0.73 LDHA (0.48) LDHALDHBHSD17B10TSHRSMN1; SMN2
SCHEMBL9657719 0.71 LDHA (0.49) LDHALDHBHSD17B10TSHRMEN1
SCHEMBL7176551 0.71 LDHA (0.56) LDHALDHBPPARA
SCHEMBL9629355 0.70 LDHA (0.48) LDHALDHBHSD17B10TSHRSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980350-A4 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES UNIV NEW MEXICO (US) 2003-01-02 EP disclosed
US-6124498-A Hydroxynaphthoic acids and derivatives UNIVERSITY OF NEW MEXICO (US) 2000-09-26 US disclosed
EP-0980350-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES The University of New Mexico (US) 2000-02-23 EP disclosed
WO-1998049130-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES THE UNIVERSITY OF NEW MEXICO (US) 1998-11-05 WO disclosed